SCHEMBL4357579

SCHEMBL4357579

O=Cc1ccc(-c2ccc3c(c2)COC(C2CCN(C(=O)c4ccccc4)CC2)O3)cc1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PTPN2 P17706 1/20 0.44
PTPN1 P18031 1/20 0.44
ALDH1A1 P00352 3/20 0.41
CYP2C19 P33261 1/20 0.41
SMN1; SMN2 Q16637 3/20 0.39
MGLL Q99685 4/20 0.39
ACHE P22303 1/20 0.39
MEN1 O00255 1/20 0.38
HPGD P15428 1/20 0.38
TSHR P16473 1/20 0.38
KMT2A Q03164 1/20 0.38
FASN P49327 2/20 0.38
HTR2B P41595 1/20 0.38
PIK3CA P42336 1/20 0.38
LMNA P02545 1/20 0.37
POLB P06746 1/20 0.37
HSD11B1 P28845 1/20 0.37

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL4520212 0.89 PTPN2 (0.47) PTPN2PTPN1ALDH1A1CYP2C19SMN1; SMN2
SCHEMBL4355595 0.87 POLB (0.54) PTPN2PTPN1ALDH1A1CYP2C19SMN1; SMN2
SCHEMBL13586029 0.86 PTPN2 (0.44) PTPN2PTPN1ALDH1A1CYP2C19SMN1; SMN2
SCHEMBL4538215 0.85 PTPN2 (0.45) PTPN2PTPN1ALDH1A1CYP2C19SMN1; SMN2
SCHEMBL13586060 0.85 SMN1; SMN2 (0.47) PTPN2PTPN1ALDH1A1CYP2C19SMN1; SMN2
SCHEMBL4349922 0.85 PTPN2 (0.43) PTPN2PTPN1ALDH1A1CYP2C19SMN1; SMN2
SCHEMBL4537918 0.85 PTPN2 (0.43) PTPN2PTPN1ALDH1A1CYP2C19SMN1; SMN2
SCHEMBL4356473 0.85 PTPN2 (0.43) PTPN2PTPN1ALDH1A1CYP2C19SMN1; SMN2
SCHEMBL13586061 0.84 MEN1 (0.49) PTPN2PTPN1ALDH1A1CYP2C19SMN1; SMN2
SCHEMBL4351628 0.83 PTPN2 (0.41) PTPN2PTPN1ALDH1A1CYP2C19SMN1; SMN2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009150144-A1 NEW GPR119MODULATORS INOVACIA AB (SE) 2009-12-17 WO claimed
WO-2009150144-A1 NEW GPR119MODULATORS INOVACIA AB (SE) 2009-12-17 WO disclosed